Vitas-M small molecule compound
methyl 4-(4,5-dimethoxy-2-nitrophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK373556
SMILES COC(=O)C1=C(C)NC2=C(C1c1cc(OC)c(cc1[N+](=O)[O-])OC)C(=O)CC(C2)(C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H26N2O7 MW 430.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O7/c1-11-18(21(26)31-6)19(20-13(23-11)9-22(2,3)10-15(20)25)12-7-16(29-4)17(30-5)8-14(12)24(27)28/h7-8,19,23H,9-10H2,1-6H3InChIKey
HJWMAMDWRAASFM-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC(=C(C=C3(N+)(=O)(O))OC)OC)C(=O)OC
COC(=O)C1=C(C)NC2=C(C1c1cc(OC)c(cc1(N+)(=O)(O))OC)C(=O)CC(C2)(C)C
InChI=1SC22H26N2O7c11118(21(26)316)19(2013(2311)922(23)1015(20)25)12716(294)17(305)814(12)24(27)28h781923H910H216H3
methyl4(45dimethoxy2nitrophenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
methyl4(45dimethoxy2nitrophenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
MFCD00785407
ZINC000019805608
ZINC000019805609
Check stock
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Check stock on Vitas-MAvailable files
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